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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alcohol > secondary alcohol > 3-cis-hydroxy-beta,epsilon-caroten-3'-one
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > 3-cis-hydroxy-beta,epsilon-caroten-3'-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > enone > 3-cis-hydroxy-beta,epsilon-caroten-3'-one
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > 3-cis-hydroxy-beta,epsilon-caroten-3'-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > 3-cis-hydroxy-beta,epsilon-caroten-3'-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > 3-cis-hydroxy-beta,epsilon-caroten-3'-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > tetraterpenoid > carotenoid > xanthophyll > carotenone > 3-cis-hydroxy-beta,epsilon-caroten-3'-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > tetraterpenoid > carotenoid > xanthophyll > carotenone > 3-cis-hydroxy-beta,epsilon-caroten-3'-one

Preferred term

3-cis-hydroxy-beta,epsilon-caroten-3'-one  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

alt_id

  • CHEBI:132920

charge

  • 0

formula

  • C40H54O2

inchi

  • InChI=1S/C40H54O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,36-37,42H,26-28H2,1-10H3/b12-11-,17-13+,18-14+,23-21+,24-22+,29-15-,30-16+,31-19+,32-20+/t36-,37+/m1/s1

inchikey

  • OABQIJAIRYEICK-UEJMDPRYSA-N

mass

  • 566.857

monoisotopicmass

  • 566.41238

smiles

  • C1(C[C@@H](CC(=C1/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/[C@@H]2C(C)(CC(C=C2C)=O)C)/C)/C)/C)/C)C)O)(C)C

subset

  • 3_STAR

synonym EXACT

  • (3'R,6R,13cis,15cis)-3'-hydroxy-4,5-didehydro-5,6-dihydro-beta,beta-caroten-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:91008

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